![methyl 2-({[(5-chloro(2-pyridyl))amino]thioxomethyl}amino)-5-ethylthiophene-3- carboxylate structure](/static/products/7082/708230-59-5.webp)
methyl 2-({[(5-chloro(2-pyridyl))amino]thioxomethyl}amino)-5-ethylthiophene-3- carboxylate
TL;DR: methyl 2-({[(5-chloro(2-pyridyl))amino]thioxomethyl}amino)-5-ethylthiophene-3- carboxylate (CAS 708230-59-5) is a chemical compound with molecular formula C14H14ClN3O2S2 and molecular weight 355.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[(5-chloro-2-pyridinyl)carbamothioylamino]-5-ethylthiophene-3-carboxylate
Also Known As: methyl 2-({[(5-chloro(2-pyridyl))amino]thioxomethyl}amino)-5-ethylthiophene-3- carboxylate, methyl 2-(3-(5-chloropyridin-2-yl)thioureido)-5-ethylthiophene-3-carboxylate, methyl 2-[(5-chloropyridin-2-yl)carbamothioylamino]-5-ethylthiophene-3-carboxylate, methyl 2-{[(5-chloropyridin-2-yl)carbamothioyl]amino}-5-ethylthiophene-3-carboxylate
| Molecular Formula | C14H14ClN3O2S2 |
|---|---|
| Molecular Weight | 355.02 g/mol |
| LogP | 3.9544 |
| Topological Polar Surface Area | 63.25 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 355.0216 |
| Heavy Atoms | 22 |
| Complexity | 685.8964 |
Chemical Identifiers
| CAS Number | 708230-59-5 |
|---|---|
| SMILES | CCC1=CC(=C(S1)NC(=S)NC2=NC=C(C=C2)Cl)C(=O)OC |
Product Overview
methyl 2-({[(5-chloro(2-pyridyl))amino]thioxomethyl}amino)-5-ethylthiophene-3- carboxylate (CAS 708230-59-5), with molecular formula C14H14ClN3O2S2 and molecular weight 355.02 g/mol. IUPAC: methyl 2-[(5-chloro-2-pyridinyl)carbamothioylamino]-5-ethylthiophene-3-carboxylate.
Chemical Property Profile of methyl 2-({[(5-chloro(2-pyridyl))amino]thioxomethyl}amino)-5-ethylthiophene-3- carboxylate
Property Insights of methyl 2-({[(5-chloro(2-pyridyl))amino]thioxomethyl}amino)-5-ethylthiophene-3- carboxylate
The XLogP value of 3.9544 indicates that methyl 2-({[(5-chloro(2-pyridyl))amino]thioxomethyl}amino)-5-ethylthiophene-3- carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.25 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 2-({[(5-chloro(2-pyridyl))amino]thioxomethyl}amino)-5-ethylthiophene-3- carboxylate. Following Lipinski's Rule of Five, methyl 2-({[(5-chloro(2-pyridyl))amino]thioxomethyl}amino)-5-ethylthiophene-3- carboxylate has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of methyl 2-({[(5-chloro(2-pyridyl))amino]thioxomethyl}amino)-5-ethylthiophene-3- carboxylate?
The CAS number of methyl 2-({[(5-chloro(2-pyridyl))amino]thioxomethyl}amino)-5-ethylthiophene-3- carboxylate is 708230-59-5.
What is the molecular formula of methyl 2-({[(5-chloro(2-pyridyl))amino]thioxomethyl}amino)-5-ethylthiophene-3- carboxylate?
The molecular formula of methyl 2-({[(5-chloro(2-pyridyl))amino]thioxomethyl}amino)-5-ethylthiophene-3- carboxylate is C14H14ClN3O2S2.
What is the molecular weight of methyl 2-({[(5-chloro(2-pyridyl))amino]thioxomethyl}amino)-5-ethylthiophene-3- carboxylate?
The molecular weight of methyl 2-({[(5-chloro(2-pyridyl))amino]thioxomethyl}amino)-5-ethylthiophene-3- carboxylate is 355.02 g/mol.
Where can I buy methyl 2-({[(5-chloro(2-pyridyl))amino]thioxomethyl}amino)-5-ethylthiophene-3- carboxylate?
You can request a quote for methyl 2-({[(5-chloro(2-pyridyl))amino]thioxomethyl}amino)-5-ethylthiophene-3- carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 2-({[(5-chloro(2-pyridyl))amino]thioxomethyl}amino)-5-ethylthiophene-3- carboxylate?
Yes, KEHONG BIO provides custom synthesis services for methyl 2-({[(5-chloro(2-pyridyl))amino]thioxomethyl}amino)-5-ethylthiophene-3- carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.